2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane

C15H19ClN4O2Si — CID 59835019

IUPAC2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane
SMILESC[Si](C)(C)CCOCn1cnc2c(-c3ccco3)nc(Cl)nc21
InChIInChI=1S/C15H19ClN4O2Si/c1-23(2,3)8-7-21-10-20-9-17-13-12(11-5-4-6-22-11)18-15(16)19-14(13)20/h4-6,9H,7-8,10H2,1-3H3
InChIKeyYDVFKQIEAZHKOV-UHFFFAOYSA-N
MW350.88 g/mol
LogP4.05
Rot. Bonds6

About 2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane

2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane (PubChem CID 59835019) has the molecular formula C15H19ClN4O2Si and a molecular weight of 350.88 g/mol. Its IUPAC name is 2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane
PubChem CID59835019
Molecular FormulaC15H19ClN4O2Si
Molecular Weight350.88 g/mol
Exact Mass350.10
IUPAC Name2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane
SMILESC[Si](C)(C)CCOCn1cnc2c(-c3ccco3)nc(Cl)nc21
InChIInChI=1S/C15H19ClN4O2Si/c1-23(2,3)8-7-21-10-20-9-17-13-12(11-5-4-6-22-11)18-15(16)19-14(13)20/h4-6,9H,7-8,10H2,1-3H3
InChIKeyYDVFKQIEAZHKOV-UHFFFAOYSA-N
XLogP4.05
TPSA65.97 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.88
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

2-[[2-chloro-6-(3-phenylmethoxyphenyl)purin-9-yl]methoxy]ethyl-trimethylsilane
CID 58285270
2-(ethoxymethyl)-6-(furan-2-yl)-9-[(4-methoxyphenyl)methyl]purine
CID 71171768
2-[(5-chloroimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl-trimethylsilane
CID 90176933
6-(furan-2-yl)-N,N-dimethyl-9-[(4-methylphenyl)methyl]purin-2-amine
CID 59835049
2-[[2-chloro-6-(6-phenylmethoxybenzimidazol-1-yl)purin-9-yl]methoxy]ethyl-trimethylsilane
CID 86614102
6-bromo-5-chloro-N-[(4-methoxyphenyl)methyl]-3-(2-trimethylsilylethoxymethyl)imidazo[4,5-b]pyridin-7-amine
CID 178083288
9-[(E)-but-2-enyl]-6-(furan-2-yl)purin-2-amine
CID 59834966
2-[(2-chloro-4-ethenylpyrrolo[2,3-d]pyrimidin-7-yl)methoxy]ethyl-trimethylsilane
CID 87223684
2-[2-chloro-6-(furan-2-yl)purin-9-yl]-4-fluoro-5-(hydroxymethyl)oxolan-3-ol
CID 155898325
2-[2-amino-6-(furan-2-yl)purin-9-yl]-N-methylacetamide
CID 59834969
1-(2-trimethylsilylethoxymethyl)benzimidazol-4-amine
CID 156708080
2-[(2,4-dichloro-5-iodopyrrolo[2,3-d]pyrimidin-7-yl)methoxy]ethyl-trimethylsilane
CID 86679621

Frequently Asked Questions

What is the IUPAC name of 2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane?
The IUPAC name of 2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane (CID 59835019) is 2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane is C[Si](C)(C)CCOCn1cnc2c(-c3ccco3)nc(Cl)nc21.
What is the InChIKey of 2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane?
The InChIKey is YDVFKQIEAZHKOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN4O2Si/c1-23(2,3)8-7-21-10-20-9-17-13-12(11-5-4-6-22-11)18-15(16)19-14(13)20/h4-6,9H,7-8,10H2,1-3H3.
What are the key properties of 2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane?
2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane has a molecular weight of 350.88 g/mol, XLogP of 4.05, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-chloro-6-(furan-2-yl)purin-9-yl]methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 59835019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).